SCHEMBL21077835

SCHEMBL21077835

CN1CCN2CCC(C)(C)CC2C1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL24697452 0.79 HRH3 (0.32) HRH3
SCHEMBL24260750 0.78 KDM2B (0.39) HRH3
SCHEMBL14463189 0.75 HTR2A (0.32)
SCHEMBL10863656 0.71 HRH3 (0.34) HRH3
SCHEMBL24069496 0.69 KDM4E (0.36)
SCHEMBL15185049 0.69
SCHEMBL12774192 0.68 HRH3 (0.37) HRH3
SCHEMBL12945956 0.68 OPRM1 (0.33)
SCHEMBL13620647 0.68 ALDH1A1 (0.38) HRH3
SCHEMBL24401977 0.68 VNN1 (0.33)

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3041841-B1 TRIAZOLOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF HOFFMANN LA ROCHE (CH) 2019-06-05 EP disclosed